1-methoxy-4-[5-(2-sulfosulfanylethylamino)pentyl]benzene

Systemtic Name: 1-methoxy-4-[5-(2-sulfosulfanylethylamino)pentyl]benzene Openeye Name: 1-methoxy-4-[5-(2-sulfosulfanylethylamino)pentyl]benzene CAS Name: 1-methoxy-4-[5-[2-(sulfothio)ethylamino]pentyl]benzene IUPAC Name: 1-methoxy-4-[5-(2-sulfosulfanylethylamino)pentyl]benzene Traditional Name: 1-methoxy-4-[5-[2-(sulfothio)ethylamino]pentyl]benzene Formula: C14H23NO4S2 MolecularWeight: 333.46672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCCNCCSS(=O)(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C14H23NO4S2/c1-19-14-8-6-13(7-9-14)5-3-2-4-10-15-11-12-20-21(16,17)18/h6-9,15H,2-5,10-12H2,1H3,(H,16,17,18)